! ! Copyright (C) 2001-2004 PWSCF group ! This file is distributed under the terms of the ! GNU General Public License. See the file `License' ! in the root directory of the present distribution, ! or http://www.gnu.org/copyleft/gpl.txt . ! MODULE g_psi_mod ! ! ... These are the variables needed in g_psi ! USE kinds, only : DP ! IMPLICIT NONE ! REAL(DP), ALLOCATABLE :: & h_diag (:),& ! diagonal part of the Hamiltonian s_diag (:) ! diagonal part of the overlap matrix ! REAL(DP), ALLOCATABLE :: & h_diag_nc (:,:),& ! diagonal part of the Hamiltonian s_diag_nc (:,:) ! diagonal part of the overlap matrix ! END MODULE g_psi_mod